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TASUMATROL_V
SpectraBase Compound ID KuFiSKC2OD5
InChI InChI=1S/C31H36O12/c1-15-19(34)12-28(27(4,5)37)22(15)31(38)26(36)40-13-29(31)20(41-16(2)32)11-21-30(14-39-21,43-17(3)33)23(29)24(28)42-25(35)18-9-7-6-8-10-18/h6-10,19-21,23-24,34,37-38H,11-14H2,1-5H3/t19-,20+,21+,23?,24-,28-,29+,30-,31+/m0/s1
InChIKey UHYTXVUDJYACPP-JXIPWMTCSA-N
Mol Weight 600.6 g/mol
Molecular Formula C31H36O12
Exact Mass 600.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DMZkjDv5q6r
Name TASUMATROL_V
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H36O12
InChI InChI=1S/C31H36O12/c1-15-19(34)12-28(27(4,5)37)22(15)31(38)26(36)40-13-29(31)20(41-16(2)32)11-21-30(14-39-21,43-17(3)33)23(29)24(28)42-25(35)18-9-7-6-8-10-18/h6-10,19-21,23-24,34,37-38H,11-14H2,1-5H3/t19-,20+,21+,23?,24-,28-,29+,30-,31+/m0/s1
InChIKey UHYTXVUDJYACPP-JXIPWMTCSA-N
Literature Reference Author Y.C.SHEN,S.S.WANG,C.T.CHIEN,Y.H.KUO,A.T.KHALIL
Literature Reference Citation J.NAT.PROD.,71,576(2008)
Literature Reference DOI 10.1021/np078016r
Molecular Weight 600.620 g/mol
Sample ID 27609
Solvent CDCl3